Home Other Building Blocks 2-Methylbenzoyl cyanide

2-Methylbenzoyl cyanide

CAS No.:
5955-73-7
Catalog Number:
AG00E9QH
Molecular Formula:
C9H7NO
Molecular Weight:
145.1580
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
≥ 98% (NMR)
1 week
United States
$162
- +
1g
95%
1 week
United States
$302
- +
Product Description
Catalog Number:
AG00E9QH
Chemical Name:
2-Methylbenzoyl cyanide
CAS Number:
5955-73-7
Molecular Formula:
C9H7NO
Molecular Weight:
145.1580
MDL Number:
MFCD06658474
IUPAC Name:
2-methylbenzoyl cyanide
InChI:
InChI=1S/C9H7NO/c1-7-4-2-3-5-8(7)9(11)6-10/h2-5H,1H3
InChI Key:
WYXWANVHOUGOBI-UHFFFAOYSA-N
SMILES:
N#CC(=O)c1ccccc1C
Properties
Complexity:
201  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
145.053g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
145.161g/mol
Monoisotopic Mass:
145.053g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
40.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties